Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022753
PROPERTIES
| NPAID | NPA022753 |
|---|---|
| CLUSTER ID | 6982 |
| NODE ID | 4811 |
| NAME | 5-hydroxy-3-methoxy-5-methyl-4-butylfuran-2(5H)-one |
| FORMULA | C10H16O4 |
| MOLECULAR WEIGHT (Da) | 200.2340 |
| ACCURATE MASS (Da) | 200.1049 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Setosphaeria |
| ORIGIN SPECIES | sp. SCSIO41009 |
| InChIKey | IWSCEYNNZLAWIU-UHFFFAOYSA-N |
| InChI | InChI=1S/C10H16O4/c1-4-5-6-7-8(13-3)9(11)14-10(7,2)12/h12H,4-6H2,1-3H3 |
| SMILES | CCCCC1=C(C(=O)OC1(C)O)OC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Pang, Xiaoyan; Lin, Xiuping; Yang, Jie; Zhou, Xuefeng; Yang, Bin; Wang, Junfeng; Liu, Yonghong Spiro-Phthalides and Isocoumarins Isolated from the Marine-Sponge-Derived Fungus Setosphaeria sp. SCSIO41009. Journal of Natural Products 2018 81 (8) 1860-1868. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.8b00345 | PMID | 30091601 |
